Compound Identification
SMILES
O=S1(=O)CCN(CC1)C1=NC2=NC(C3=CC=C(CN4CCC(CC4)C4=NC(=NN4)C4=CC=CC=N4)C=C3)=C(C=C2C=N1)C1=CC=CC=C1
InChIKey
InChIKey=BUBLIDZZMNUPQQ-UHFFFAOYSA-N
Formula
C36H35N9O2S
Mass
657.8
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Piperidines
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Subclass
Benzylpiperidines
- Level 5 N-benzylpiperidines
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Subclass
Benzylpiperidines
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Class
Piperidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Piperidines
Subclass
Benzylpiperidines
Intermediate Tree Nodes
Not available
Direct Parent
N-benzylpiperidines
Alternative Parents
Phenylpyridines Pyridyl-1,2,4-triazoles Pyrido[2,3-d]pyrimidines Benzylamines Dialkylarylamines Phenylmethylamines Aralkylamines Aminopyrimidines and derivatives Thiomorpholines Triazoles Heteroaromatic compounds Sulfones Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-benzylpiperidine - 2-phenylpyridine - 3-phenylpyridine - Pyridyltriazole - Pyridyl-1,2,4-triazole - Pyrido[2,3-d]pyrimidine - Pyridopyrimidine - Benzylamine - Phenylmethylamine - Dialkylarylamine - Aralkylamine - Aminopyrimidine - Benzenoid - Monocyclic benzene moiety - Pyridine - Pyrimidine - 1,4-thiazinane - Sulfone - Azole - Heteroaromatic compound - Triazole - 1,2,4-triazole - Tertiary amine - Tertiary aliphatic amine - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.
External Descriptors
Not available